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Title: Materials Data on SrZn5 by Materials Project

Abstract

SrZn5 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Sr is bonded in a 9-coordinate geometry to seventeen Zn atoms. There are a spread of Sr–Zn bond distances ranging from 3.29–3.78 Å. There are four inequivalent Zn sites. In the first Zn site, Zn is bonded in a 11-coordinate geometry to three equivalent Sr and eight Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.57–2.94 Å. In the second Zn site, Zn is bonded in a 10-coordinate geometry to three equivalent Sr and seven Zn atoms. There are two shorter (2.60 Å) and two longer (2.74 Å) Zn–Zn bond lengths. In the third Zn site, Zn is bonded in a 12-coordinate geometry to four equivalent Sr and eight Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.57–2.66 Å. In the fourth Zn site, Zn is bonded in a 10-coordinate geometry to three equivalent Sr and seven Zn atoms. Both Zn–Zn bond lengths are 2.97 Å.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-1435
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; SrZn5; Sr-Zn
OSTI Identifier:
1190625
DOI:
10.17188/1190625

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on SrZn5 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1190625.
Persson, Kristin, & Project, Materials. Materials Data on SrZn5 by Materials Project. United States. doi:10.17188/1190625.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on SrZn5 by Materials Project". United States. doi:10.17188/1190625. https://www.osti.gov/servlets/purl/1190625. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1190625,
title = {Materials Data on SrZn5 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {SrZn5 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Sr is bonded in a 9-coordinate geometry to seventeen Zn atoms. There are a spread of Sr–Zn bond distances ranging from 3.29–3.78 Å. There are four inequivalent Zn sites. In the first Zn site, Zn is bonded in a 11-coordinate geometry to three equivalent Sr and eight Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.57–2.94 Å. In the second Zn site, Zn is bonded in a 10-coordinate geometry to three equivalent Sr and seven Zn atoms. There are two shorter (2.60 Å) and two longer (2.74 Å) Zn–Zn bond lengths. In the third Zn site, Zn is bonded in a 12-coordinate geometry to four equivalent Sr and eight Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.57–2.66 Å. In the fourth Zn site, Zn is bonded in a 10-coordinate geometry to three equivalent Sr and seven Zn atoms. Both Zn–Zn bond lengths are 2.97 Å.},
doi = {10.17188/1190625},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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